2-(2-trimethylsilylethyl)cyclododecan-1-one

C17H34OSi — CID 10333999

IUPAC2-(2-trimethylsilylethyl)cyclododecan-1-one
SMILESC[Si](C)(C)CCC1CCCCCCCCCCC1=O
InChIInChI=1S/C17H34OSi/c1-19(2,3)15-14-16-12-10-8-6-4-5-7-9-11-13-17(16)18/h16H,4-15H2,1-3H3
InChIKeyMRCNQODSVRALBC-UHFFFAOYSA-N
MW282.54 g/mol
LogP5.81
Rot. Bonds3

About 2-(2-trimethylsilylethyl)cyclododecan-1-one

2-(2-trimethylsilylethyl)cyclododecan-1-one (PubChem CID 10333999) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is 2-(2-trimethylsilylethyl)cyclododecan-1-one.

Molecular Properties

Compound Name2-(2-trimethylsilylethyl)cyclododecan-1-one
PubChem CID10333999
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Name2-(2-trimethylsilylethyl)cyclododecan-1-one
SMILESC[Si](C)(C)CCC1CCCCCCCCCCC1=O
InChIInChI=1S/C17H34OSi/c1-19(2,3)15-14-16-12-10-8-6-4-5-7-9-11-13-17(16)18/h16H,4-15H2,1-3H3
InChIKeyMRCNQODSVRALBC-UHFFFAOYSA-N
XLogP5.81
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Muskone
CID 10947
6,10,14-Trimethyl-2-pentadecanone
CID 10408
Muscone
CID 7160826
3-Methylpentadecan-2-one
CID 20648314
6-Tridecanone, 3,9-diethyl-
CID 113430
3,11-Dimethylnonacosan-2-one
CID 205987
4-Methylcyclopentadecanone
CID 118194
(6R,10R)-6,10,14-trimethylpentadecan-2-one
CID 1810793
(6S,10S)-6,10,14-trimethylpentadecan-2-one
CID 1810797
25-Methyl-10-triacontanone
CID 86172607
3S,11S-Dimethylnonacosan-2-one
CID 14211089
6-Methyl-2-octadecanone
CID 46193078

Frequently Asked Questions

What is the IUPAC name of 2-(2-trimethylsilylethyl)cyclododecan-1-one?
The IUPAC name of 2-(2-trimethylsilylethyl)cyclododecan-1-one (CID 10333999) is 2-(2-trimethylsilylethyl)cyclododecan-1-one.
What is the SMILES notation for 2-(2-trimethylsilylethyl)cyclododecan-1-one?
The canonical SMILES for 2-(2-trimethylsilylethyl)cyclododecan-1-one is C[Si](C)(C)CCC1CCCCCCCCCCC1=O.
What is the InChIKey of 2-(2-trimethylsilylethyl)cyclododecan-1-one?
The InChIKey is MRCNQODSVRALBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34OSi/c1-19(2,3)15-14-16-12-10-8-6-4-5-7-9-11-13-17(16)18/h16H,4-15H2,1-3H3.
What are the key properties of 2-(2-trimethylsilylethyl)cyclododecan-1-one?
2-(2-trimethylsilylethyl)cyclododecan-1-one has a molecular weight of 282.54 g/mol, XLogP of 5.81, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-trimethylsilylethyl)cyclododecan-1-one is sourced from PubChem (CID 10333999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).